(3-nitrophenyl) 7-chloranyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (3-nitrophenyl) 7-chloranyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (3-nitrophenyl) 7-chloro-3-methyl-benzofuran-2-carboxylate CAS Name: 7-chloro-3-methyl-2-benzofurancarboxylic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 7-chloro-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 7-chloro-3-methyl-coumarilic acid (3-nitrophenyl) ester Formula: C16H10ClNO5 MolecularWeight: 331.7073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2Cl)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2Cl)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClNO5/c1-9-12-6-3-7-13(17)15(12)23-14(9)16(19)22-11-5-2-4-10(8-11)18(20)21/h2-8H,1H3